Base information
| Cat. No. | |
| CAS No. | 183658-72-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C56H68N12O14S2 |
| Molecular Weight | 1197.34 |
| Exact Mass | 1196.44 |
| XLogP3 | 4.7868 |
| Mr | 332.43 |
| PSA | 474.81 |
| Sequence | - |
| Atom number | 152 |
| Bond number | 157 |
| Ring number | 6 |
| Rotor number | 23 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H]1NC(=O)[C@H](NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@@H](CSSC[C@H](NC(=O)[C@@H](NC1=O)[C@H](O)C)C(=O)N[C@@H](C(=O)N)Cc1ccc(cc1)O)NC(=O)[C@H](Cc1ccc(cc1)[N+](=O)[O-])NC(=O)C)Cc1c[nH]c2c1cccc2 |
